N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide

Systemtic Name: N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanamide Openeye Name: N-[2-(4-methyl-1-piperidyl)-2-(2-thienyl)ethyl]-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide CAS Name: N-[2-(4-methyl-1-piperidinyl)-2-thiophen-2-ylethyl]-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide IUPAC Name: N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide Traditional Name: 3-(4-keto-1,2,3-benzotriazin-3-yl)-N-[2-(4-methylpiperidino)-2-(2-thienyl)ethyl]propionamide Formula: C22H27N5O2S MolecularWeight: 425.54708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(CNC(=O)CCN2C(=O)C3=CC=CC=C3N=N2)C4=CC=CS4

Isomeric SMILES

CC1CCN(CC1)C(CNC(=O)CCN2C(=O)C3=CC=CC=C3N=N2)C4=CC=CS4

InChI

InChI=1S/C22H27N5O2S/c1-16-8-11-26(12-9-16)19(20-7-4-14-30-20)15-23-21(28)10-13-27-22(29)17-5-2-3-6-18(17)24-25-27/h2-7,14,16,19H,8-13,15H2,1H3,(H,23,28)